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	hartrees
Energy at 0K	-47.314929
Energy at 298.15K	-47.317390
HF Energy	-47.264417
Nuclear repulsion energy	16.187169

Mode Number	Symmetry	Frequency (cm^-1)	Scaled Frequency (cm^-1)	IR Intensities (km mol^-1)
1	A₁	3020	2864	67.98
2	A₁	1152	1093	37.96
3	A₁	633	601	14.50
4	E	3092	2933	43.51
4	E	3092	2933	43.50
5	E	1513	1435	7.76
5	E	1513	1435	7.76
6	E	495	470	222.98
6	E	495	470	223.00

Atom	x (Å)	y (Å)	z (Å)
Li1	0.000	0.000	-1.595
C2	0.000	0.000	0.393
H3	0.000	1.017	0.808
H4	-0.881	-0.509	0.808
H5	0.881	-0.509	0.808

	Li1	C2	H3	H4	H5
Li1		1.9878	2.6095	2.6095	2.6095
C2	1.9878		1.0987	1.0987	1.0987
H3	2.6095	1.0987		1.7619	1.7619
H4	2.6095	1.0987	1.7619		1.7619
H5	2.6095	1.0987	1.7619	1.7619

atom1	atom2	atom3	angle	atom1	atom2	atom3	angle
Li1	C2	H3	112.207	Li1	C2	H4	112.207
Li1	C2	H5	112.207	H3	C2	H4	106.602
H3	C2	H5	106.602	H4	C2	H5	106.602

All results from a given calculation for CH₃Li (methyl lithium)

using model chemistry: B2PLYP=FULL/6-31G*

States and conformations

	Computational Chemistry Comparison and Benchmark DataBase Release 22 (May 2022) Standard Reference Database 101 National Institute of Standards and Technology
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All results from a given calculation for CH3Li (methyl lithium)

using model chemistry: B2PLYP=FULL/6-31G*

States and conformations

All results from a given calculation for CH₃Li (methyl lithium)